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The Journal of Chemical Physics
|
November 7, 2012
Arbitrary order El'yashevich-Wilson B tensor formulas for the most frequently used internal coordinates in molecular vibrational analyses
David S Hollman, Henry F Schaefer
The Journal of Chemical Physics
|
March 3, 2012
In search of the next Holy Grail of polyoxide chemistry: explicitly correlated ab initio full quartic force fields for HOOH, HOOOH, HOOOOH, and their isotopologues
David S Hollman, Henry F Schaefer
The Journal of Chemical Physics
|
July 5, 2012
From strong van der Waals complexes to hydrogen bonding: From CO⋯H2O to CS⋯H2O and SiO⋯H2O complexes
Yan Zhang, David S Hollman, Henry F Schaeffer
The Journal of Chemical Physics
|
February 22, 2013
Explicitly correlated atomic orbital basis second order Møller-Plesset theory
David S Hollman, Jeremiah J Wilke, Henry F Schaefer
Physical Chemistry Chemical Physics : PCCP
|
November 25, 2010
The benzene+OH potential energy surface: intermediates and transition states
David S Hollman, Andrew C Simmonett, Henry F Schaefer
The Journal of Chemical Physics
|
April 24, 2015
A tight distance-dependent estimator for screening three-center Coulomb integrals over Gaussian basis functions
David S Hollman, Henry F Schaefer, Edward F Valeev
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
April 12, 2013
Tetragermacyclobutadiene: energetically disfavored with respect to its structural isomers
J Wayne Mullinax, David S Hollman, Henry F Schaefer
The Journal of Chemical Physics
|
February 18, 2014
Semi-exact concentric atomic density fitting: reduced cost and increased accuracy compared to standard density fitting
David S Hollman, Henry F Schaefer, Edward F Valeev
Page
of 1
Search research articles
Search
Showing results (1-10 of 8) with videos related to
Sort By:
Page
of 1
The Journal of Chemical Physics
|
November 7, 2012
Arbitrary order El'yashevich-Wilson B tensor formulas for the most frequently used internal coordinates in molecular vibrational analyses
David S Hollman, Henry F Schaefer
The Journal of Chemical Physics
|
March 3, 2012
In search of the next Holy Grail of polyoxide chemistry: explicitly correlated ab initio full quartic force fields for HOOH, HOOOH, HOOOOH, and their isotopologues
David S Hollman, Henry F Schaefer
The Journal of Chemical Physics
|
July 5, 2012
From strong van der Waals complexes to hydrogen bonding: From CO⋯H2O to CS⋯H2O and SiO⋯H2O complexes
Yan Zhang, David S Hollman, Henry F Schaeffer
The Journal of Chemical Physics
|
February 22, 2013
Explicitly correlated atomic orbital basis second order Møller-Plesset theory
David S Hollman, Jeremiah J Wilke, Henry F Schaefer
Physical Chemistry Chemical Physics : PCCP
|
November 25, 2010
The benzene+OH potential energy surface: intermediates and transition states
David S Hollman, Andrew C Simmonett, Henry F Schaefer
The Journal of Chemical Physics
|
April 24, 2015
A tight distance-dependent estimator for screening three-center Coulomb integrals over Gaussian basis functions
David S Hollman, Henry F Schaefer, Edward F Valeev
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
April 12, 2013
Tetragermacyclobutadiene: energetically disfavored with respect to its structural isomers
J Wayne Mullinax, David S Hollman, Henry F Schaefer
The Journal of Chemical Physics
|
February 18, 2014
Semi-exact concentric atomic density fitting: reduced cost and increased accuracy compared to standard density fitting
David S Hollman, Henry F Schaefer, Edward F Valeev
Page
of 1